1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine

C17H32N2 — CID 106172740

IUPAC1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine
SMILESCCC1CNC(CC)(CC)CN1CCC1=CCCC1
InChIInChI=1S/C17H32N2/c1-4-16-13-18-17(5-2,6-3)14-19(16)12-11-15-9-7-8-10-15/h9,16,18H,4-8,10-14H2,1-3H3
InChIKeyDKTSNKVGZUNCKM-UHFFFAOYSA-N
MW264.46 g/mol
LogP3.73
Rot. Bonds6

About 1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine

1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine (PubChem CID 106172740) has the molecular formula C17H32N2 and a molecular weight of 264.46 g/mol. Its IUPAC name is 1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine.

Molecular Properties

Compound Name1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine
PubChem CID106172740
Molecular FormulaC17H32N2
Molecular Weight264.46 g/mol
Exact Mass264.26
IUPAC Name1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine
SMILESCCC1CNC(CC)(CC)CN1CCC1=CCCC1
InChIInChI=1S/C17H32N2/c1-4-16-13-18-17(5-2,6-3)14-19(16)12-11-15-9-7-8-10-15/h9,16,18H,4-8,10-14H2,1-3H3
InChIKeyDKTSNKVGZUNCKM-UHFFFAOYSA-N
XLogP3.73
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.46
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine?
The IUPAC name of 1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine (CID 106172740) is 1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine.
What is the SMILES notation for 1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine?
The canonical SMILES for 1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine is CCC1CNC(CC)(CC)CN1CCC1=CCCC1.
What is the InChIKey of 1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine?
The InChIKey is DKTSNKVGZUNCKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2/c1-4-16-13-18-17(5-2,6-3)14-19(16)12-11-15-9-7-8-10-15/h9,16,18H,4-8,10-14H2,1-3H3.
What are the key properties of 1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine?
1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine has a molecular weight of 264.46 g/mol, XLogP of 3.73, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine is sourced from PubChem (CID 106172740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).